Fe6BiB (P4/mmm) - relaxed - phonon dispersion
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -4.61 THz
Fe6BiB (P4/mmm) - relaxed
.cif fileRelaxed with Orb v3; 0.03 eV/Å threshold; final energy = -58.1543 eV; energy change = -7.8850 eV; symmetry: P4/mmm → P4/mmm
3mo
1 input asset
Loading compatible actions...
Loading comments...